6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one

C18H14F2N4O2 — CID 134489933

About 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one

6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one (PubChem CID 134489933) has the molecular formula C18H14F2N4O2 and a molecular weight of 356.33 g/mol. Its IUPAC name is 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one.

Molecular Properties

• Compound Name: 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one
• PubChem CID: 134489933
• Molecular Formula: C18H14F2N4O2
• Molecular Weight: 356.33 g/mol
• Exact Mass: 356.11
• IUPAC Name: 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one
• SMILES: Cc1cc(Cn2c(=O)n(C)c3ncc(-c4ccc(F)c(F)c4)cc32)no1
• InChI: InChI=1S/C18H14F2N4O2/c1-10-5-13(22-26-10)9-24-16-7-12(8-21-17(16)23(2)18(24)25)11-3-4-14(19)15(20)6-11/h3-8H,9H2,1-2H3
• InChIKey: OLFGRMRNTCSNFL-UHFFFAOYSA-N
• XLogP: 3.02
• TPSA: 65.85 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	356.33
LogP ≤ 5	3.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?

The IUPAC name of 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one (CID 134489933) is 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one.

What is the SMILES notation for 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?

The canonical SMILES for 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one is Cc1cc(Cn2c(=O)n(C)c3ncc(-c4ccc(F)c(F)c4)cc32)no1.

What is the InChIKey of 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?

The InChIKey is OLFGRMRNTCSNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N4O2/c1-10-5-13(22-26-10)9-24-16-7-12(8-21-17(16)23(2)18(24)25)11-3-4-14(19)15(20)6-11/h3-8H,9H2,1-2H3.

What are the key properties of 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?

6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one has a molecular weight of 356.33 g/mol, XLogP of 3.02, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(3,4-difluorophenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 134489933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).